Chem
J-GLOBAL ID：200907090607809924   Nikkaji number：J2.210.678C

4-O,5-O-[(6-Amino-1,2,6-trideoxy-α-D-glucopyranose)-1,2-diylimino[[3-O-(2,6-diamino-2,6-dideoxy-β-L-idopyranosyl)-1,5-dideoxy-β-D-ribofuranose]-5,1-diyl]]-2-deoxy-D-streptamine

4-O,5-O-[(6-アミノ-1,2,6-トリデオキシ-α-D-グルコピラノース)-1,2-ジイルイミノ[[3-O-(2,6-ジアミノ-2,6-ジデオキシ-β-L-イドピラノシル)-1,5-ジデオキシ-β-D-リボフラノース]-5,1-ジイル]]-2-デオキシ-D-ストレプタミン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C23H44N6O12
Molecular formula furigana： C23-H44-N6-O12
Molecular weight： 596.635
InChI： InChI=1S/C23H44N6O12/c24-2-7-13(31)15(33)10(28)21(36-7)40-19-9-4-29-11-16(34)14(32)8(3-25)37-22(11)39-18-6(27)1-5(26)12(30)20(18)41-23(38-9)17(19)35/h5-23,29-35H,1-4,24-28H2/t5-,6+,7+,8-,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+/m1/s1
InChI key： DXIORKRGAWCDSD-LSWIJEOBSA-N
SMILES： NC[C@@H]1O[C@H](O[C@@H]2[C@H]3CN[C@@H]4[C@@H](O)[C@H](O)[C@@H](CN)O[C@@H]4O[C@@H]4[C@@H](N)C[C@@H](N)[C@H](O)[C@H]4O[C@H](O3)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • 4-O,5-O-[(6-アミノ-1,2,6-トリデオキシ-α-D-グルコピラノース)-1,2-ジイルイミノ[[3-O-(2,6-ジアミノ-2,6-ジデオキシ-β-L-イドピラノシル)-1,5-ジデオキシ-β-D-リボフラノース]-5,1-ジイル]]-2-デオキシ-D-ストレプタミン
  • (1S,3R,4S,5R,7S,8R,10R,12R,13S,14R,15R,18R,19S,20R)-5,7-ジアミノ-19-{[(2R,3R,4R,5S,6S)-3-アミノ-6-(アミノメチル)-4,5-ジヒドロキシオキサン-2-イル]オキシ}-12-(アミノメチル)-2,9,11,21-テトラオキサ-16-アザテトラシクロ[16.2.1.03,8.010,15]ヘンイコサン-4,13,14,20-テトラオール
  • (1S,3R,4S,5R,7S,8R,10R,12R,13S,14R,15R,18R,19S,20R)-5,7-diamino-19-{[(2R,3R,4R,5S,6S)-3-amino-6-(aminomethyl)-4,5-dihydroxyoxan-2-yl]oxy}-12-(aminomethyl)-2,9,11,21-tetraoxa-16-azatetracyclo[16.2.1.03,8.010,15]henicosane-4,13,14,20-tetrol
Other name (1)：
  • 4-O,5-O-[(6-Amino-1,2,6-trideoxy-α-D-glucopyranose)-1,2-diylimino[[3-O-(2,6-diamino-2,6-dideoxy-β-L-idopyranosyl)-1,5-dideoxy-β-D-ribofuranose]-5,1-diyl]]-2-deoxy-D-streptamine
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